2-ethylsulfanyl-3-methyl-spiro[4a,6-dihydro-2H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one

Systemtic Name: 2-ethylsulfanyl-3-methyl-spiro[4a,6-dihydro-2H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one Openeye Name: 2-ethylsulfanyl-3-methyl-spiro[4a,6-dihydro-2H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one CAS Name: 2-(ethylthio)-3-methyl-4-spiro[4a,6-dihydro-2H-benzo[h]quinazoline-5,1'-cyclohexane]one IUPAC Name: 2-ethylsulfanyl-3-methylspiro[4a,6-dihydro-2H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one Traditional Name: 2-(ethylthio)-3-methyl-spiro[4a,6-dihydro-2H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one Formula: C20H26N2OS MolecularWeight: 342.49824

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1N=C2C(C(=O)N1C)C3(CCCCC3)CC4=CC=CC=C42

Isomeric SMILES

CCSC1N=C2C(C(=O)N1C)C3(CCCCC3)CC4=CC=CC=C42

InChI

InChI=1S/C20H26N2OS/c1-3-24-19-21-17-15-10-6-5-9-14(15)13-20(11-7-4-8-12-20)16(17)18(23)22(19)2/h5-6,9-10,16,19H,3-4,7-8,11-13H2,1-2H3